COC(=O)Nc1nc2cc(C(=O)c3ccc(F)cc3)ccc2[nH]1
Name: Methyl [5-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate
SMILES: COC(=O)Nc1nc2cc(C(=O)c3ccc(F)cc3)ccc2[nH]1

Molecular Processing

Molecular formula
C16H12FN3O3
Molecular weight
313.29
Exact mass
313.0863
XLogP
3.11
TPSA
84.08
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
81.95

Supplementary Information

Details werden geladen…

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